Vitas-M small molecule compound

6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl N-[(4-methylphenyl)sulfonyl]-L-valinate

Catalog ID
STK717844
SMILES CC([C@@H](C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H24ClNO6S MW 526.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClNO6S/c1-16(2)26(29-36(32,33)19-11-9-17(3)10-12-19)27(31)35-24-15-23-21(13-22(24)28)20(14-25(30)34-23)18-7-5-4-6-8-18/h4-16,26,29H,1-3H3/t26-/m0/s1
InChIKey
LHRUZBWMDHAMPW-SANMLTNESA-N
Synonyms

(6CHLORO2OXO4PHENYLCHROMEN7YL)(2S)3METHYL2((4METHYLPHENYL)SULFONYLAMINO)BUTANOATE
6chloro2oxo4phenyl2Hchromen7yl3methyl2(4methylphenylsulfonamido)butanoate
6chloro2oxo4phenyl2Hchromen7ylN((4methylphenyl)sulfonyl)Lvalinate
CC((C@@H)(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C
CC(C(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1)NS(=O)(=O)c1ccc(cc1)C)C
CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)OC2=C(C=C3C(=CC(=O)OC3=C2)C4=CC=CC=C4)Cl
InChI=1SC27H24ClNO6Sc116(2)26(2936(3233)1911917(3)101219)27(31)3524152321(1322(24)28)20(1425(30)3423)187546818h4162629H13H3t26m0s1
MFCD10041743
ZINC000001776156
ZINC01776156
ZINC1776156

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.